Vitas-M small molecule compound
ethyl 2-[({5-chloro-2-[(4-methylbenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK913398
SMILES CCOC(=O)c1c(NC(=O)c2nc(SCc3ccc(cc3)C)ncc2Cl)sc2c1CCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H22ClN3O3S2 MW 488.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O3S2/c1-3-30-22(29)18-15-5-4-6-17(15)32-21(18)27-20(28)19-16(24)11-25-23(26-19)31-12-14-9-7-13(2)8-10-14/h7-11H,3-6,12H2,1-2H3,(H,27,28)InChIKey
CHMGTXRVGPDLBL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=NC(=NC=C3Cl)SCC4=CC=C(C=C4)C
ethyl2(((5chloro2((4methylbenzyl)sulfanyl)pyrimidin4yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ethyl2((5chloro2((4methylphenyl)methylsulfanyl)pyrimidine4carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC23H22ClN3O3S2c133022(29)181554617(15)3221(18)2720(28)1916(24)112523(2619)3112149713(2)81014h711H3612H212H3(H2728)
MFCD07428355
ZINC000012062587
ZINC12062587
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